SCHEMBL24167449

SCHEMBL24167449

CC#CC(=O)Nc1cc2c(Nc3ccc(Oc4ccn5ncnc5c4)c(Cl)c3)ncnc2cc1OCCN(C)C

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.49
ERBB2 P04626 5/20 0.49
KDR P35968 1/20 0.47
NQO2 P16083 1/20 0.44
FECH P22830 1/20 0.44
MYH14 Q7Z406 1/20 0.44
RIPK3 Q9Y572 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24167469 0.93 EGFR (0.57) EGFRERBB2NQO2FECHMYH14
SCHEMBL24167238 0.92 EGFR (0.51) EGFRERBB2KDRNQO2FECH
SCHEMBL24167237 0.90 EGFR (0.57) EGFRERBB2KDR
SCHEMBL24167234 0.90 EGFR (0.52) EGFRERBB2KDRNQO2FECH
SCHEMBL26005722 0.90 EGFR (0.56) EGFRERBB2NQO2FECHMYH14
SCHEMBL24167230 0.89 EGFR (0.48) EGFRERBB2KDR
SCHEMBL24167697 0.87 EGFR (0.47) EGFRERBB2KDRNQO2FECH
SCHEMBL24167245 0.86 EGFR (0.55) EGFRERBB2NQO2FECHMYH14
SCHEMBL24168312 0.86 EGFR (0.51) EGFRERBB2KDRNQO2FECH
SCHEMBL24167942 0.86 EGFR (0.51) EGFRERBB2KDRNQO2FECH

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265098-A1 ALKYNE QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN INC. 2023-08-24 US disclosed
WO-2022006386-A1 ALKYNE QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN THERAPEUTICS, INC. (US) 2022-01-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230265098-A1 ALKYNE QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 ERBB2, ERBB3, CHEK2 EGFR 6/4885ERBB2 1/4885KDR 227/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.